2-[4-bromanyl-2-[1-(2-chlorophenyl)pyrazol-4-yl]carbonyl-phenoxy]propanoic acid

Systemtic Name: 2-[4-bromanyl-2-[1-(2-chlorophenyl)pyrazol-4-yl]carbonyl-phenoxy]propanoic acid Openeye Name: 2-[4-bromo-2-[1-(2-chlorophenyl)pyrazole-4-carbonyl]phenoxy]propanoic acid CAS Name: 2-[4-bromo-2-[[1-(2-chlorophenyl)-4-pyrazolyl]-oxomethyl]phenoxy]propanoic acid IUPAC Name: 2-[4-bromo-2-[1-(2-chlorophenyl)pyrazole-4-carbonyl]phenoxy]propanoic acid Traditional Name: 2-[4-bromo-2-[1-(2-chlorophenyl)pyrazole-4-carbonyl]phenoxy]propionic acid Formula: C19H14BrClN2O4 MolecularWeight: 449.68246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=C(C=C(C=C1)Br)C(=O)C2=CN(N=C2)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C(=O)O)OC1=C(C=C(C=C1)Br)C(=O)C2=CN(N=C2)C3=CC=CC=C3Cl

InChI

InChI=1S/C19H14BrClN2O4/c1-11(19(25)26)27-17-7-6-13(20)8-14(17)18(24)12-9-22-23(10-12)16-5-3-2-4-15(16)21/h2-11H,1H3,(H,25,26)